Information card for entry 2222221

Structure parameters

• Chemical name: Poly[[(μ-1<i>H</i>-benzimidazole-5,6-dicarboxylato)zinc(II)] monohydrate]
• Formula: C9 H6 N2 O5 Zn
• Calculated formula: C9 H6 N2 O5 Zn
• Title of publication: Poly[[(μ-1<i>H</i>-benzimidazole-5,6-dicarboxylato)zinc(II)] monohydrate]
• Authors of publication: Li, Zhao-yang; Dai, Jing-wei; Yue, Shan-tang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 7
• Pages of publication: m775
• a: 6.4735 ± 0.0005 Å
• b: 8.1836 ± 0.0006 Å
• c: 18.4407 ± 0.0012 Å
• α: 90°
• β: 104.397 ± 0.002°
• γ: 90°
• Cell volume: 946.25 ± 0.12 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0295
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for significantly intense reflections: 0.0693
• Weighted residual factors for all reflections included in the refinement: 0.0715
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes